Cyclohexylamine

Cyclohexylamine

SCHEMBL11565837

CC(O)C(=O)O.NC1CCCCC1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1

The experimentally established mechanism targets of Cyclohexylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
MMP8 P22894 2/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.44
GRM2 Q14416 1/20 0.39
EPHX1 P07099 1/20 0.37
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.35
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Cyclohexylamine SCHEMBL28154438 0.86 MMP8 (0.46) MMP8MMP1MMP2GRM2EPHX1
Cadaverine Tartrate SCHEMBL2998062 0.84 TSHR (0.48) TP53MMP8MMP1MMP2GRM2
Cyclohexylamine SCHEMBL4064700 0.83 MMP8 (0.44) TP53MMP8MMP1MMP2ALDH1A1
Cyclohexylamine SCHEMBL9082115 0.83 MMP8 (0.44) MMP8MMP1MMP2GRM2EPHX1
Valine SCHEMBL28257081 0.81 SLC7A5 (0.60) MMP8MMP1MMP2GRM2ALDH1A1
Valine SCHEMBL8706964 0.81 SLC7A5 (0.60) MMP8MMP1MMP2GRM2ALDH1A1
Cyclohexylamine SCHEMBL27738388 0.80 MMP8 (0.43) MMP8MMP1MMP2EPHX1ALDH1A1
Cyclohexylamine SCHEMBL27242018 0.80 MMP8 (0.43) MMP8MMP1MMP2EPHX1ALDH1A1
Cyclohexylamine SCHEMBL1427270 0.80 MMP8 (0.43) MMP8MMP1MMP2EPHX1ALDH1A1
Cyclohexylamine SCHEMBL578785 0.80 CES2 (0.43) MMP8MMP1MMP2EPHX1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4144159-A POLYGLYCIDYL ETHERS OF POLYPHENOLS, CHAIN EXTENSION, SALT FORMATION, QUATERNIZATION PPG INDUSTRIES, INC. (US) 1979-03-13 US disclosed
US-4115226-A FOR COATING FERROUS METALS PPG INDUSTRIES, INC. (US) 1978-09-19 US disclosed
US-4110287-A Cataphoretic N-heterocyclic-containing resins for electrodeposition PPG INDUSTRIES, INC. (US) 1978-08-29 US disclosed
US-4081343-A CATIONIC POLYAMINE RESIN, PIGMENT PASTE PPG INDUSTRIES, INC. (US) 1978-03-28 US disclosed